3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one

C14H18N2O3 — CID 115064883

IUPAC3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one
SMILESO=C1OC(C2CCNCC2)CN1c1cccc(O)c1
InChIInChI=1S/C14H18N2O3/c17-12-3-1-2-11(8-12)16-9-13(19-14(16)18)10-4-6-15-7-5-10/h1-3,8,10,13,15,17H,4-7,9H2
InChIKeyJMWJQAUJKNUATA-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.72
Rot. Bonds2

About 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one

3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one (PubChem CID 115064883) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one
PubChem CID115064883
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one
SMILESO=C1OC(C2CCNCC2)CN1c1cccc(O)c1
InChIInChI=1S/C14H18N2O3/c17-12-3-1-2-11(8-12)16-9-13(19-14(16)18)10-4-6-15-7-5-10/h1-3,8,10,13,15,17H,4-7,9H2
InChIKeyJMWJQAUJKNUATA-UHFFFAOYSA-N
XLogP1.72
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one?
The IUPAC name of 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one (CID 115064883) is 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one is O=C1OC(C2CCNCC2)CN1c1cccc(O)c1.
What is the InChIKey of 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one?
The InChIKey is JMWJQAUJKNUATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c17-12-3-1-2-11(8-12)16-9-13(19-14(16)18)10-4-6-15-7-5-10/h1-3,8,10,13,15,17H,4-7,9H2.
What are the key properties of 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one?
3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one has a molecular weight of 262.31 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxyphenyl)-5-piperidin-4-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 115064883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).